# Fileset
[vasp-settings.tar.lzma](https://mdr.nims.go.jp/filesets/f39926fa-26be-477d-a858-c0566bf4e388/download)
## Creator
[Atsushi Togo](https://orcid.org/0000-0001-8393-9766)
## Rights
Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/)
## Other metadata
[Ab-initio phonon calculation for K2CaH8(N3O)4 / Ccce (68) / materials id 707762](https://mdr.nims.go.jp/datasets/4c9aea7b-ef0c-4212-b48d-7f392786a1ff)
## Fulltext
vasp-settings/KPOINTS-forceAutomatic mesh0Gamma 1 2 3 0.000 0.000 0.000vasp-settings/PAW_dataset.txt 8K 39.09800000 7.00000000 PAW_PBE K_pv 17Jan2003 4Ca 40.07800000 8.00000000 PAW_PBE Ca_pv 06Sep2000 32H 1.00000000 1.00000000 PAW_PBE H 15Jun2001 48N 14.00100000 5.00000000 PAW_PBE N 08Apr2002 16O 16.00000000 6.00000000 PAW_PBE O 08Apr2002 vasp-settings/INCAR-relax PREC = Accurate GGA = PS IBRION = 2 NSW = 20 NELMIN = 5 ISIF = 3 ENCUT = 520.000000 EDIFF = 1.000000e-08 EDIFFG = -1.000000e-08 ISMEAR = 0 SIGMA = 1.000000e-02 IALGO = 38 LREAL = .FALSE. ADDGRID = .TRUE. LWAVE = .FALSE. LCHARG = .FALSE. 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0.1247950400000000 0.1003674000000000 0.8744852900000000 0.3752049600000000 0.8996326000000000 0.3744852900000000 0.8752049600000000 0.1003674000000000 0.6255147100000000 0.8752049600000000 0.8996326000000000 0.1255147100000000 0.3752049600000000 0.8996326000000000 0.6255147100000000 0.1247950400000000 0.1003674000000000 0.1255147100000000 0.6247950400000000 0.8996326000000000 0.8744852900000000 0.6247950400000000 0.1003674000000000 0.3744852900000000 0.1247950400000000vasp-settings/INCAR-force PREC = Accurate GGA = PS IBRION = -1 NELMIN = 5 ENCUT = 520.000000 EDIFF = 1.000000e-08 ISMEAR = 0 SIGMA = 1.000000e-02 IALGO = 38 LREAL = .FALSE. ADDGRID = .TRUE. LWAVE = .FALSE. LCHARG = .FALSE. NPAR = 4vasp-settings/KPOINTS-relaxAutomatic mesh0Gamma 1 2 3 0.000 0.000 0.000